Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 2/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | KDM4A | O75164 | 1/20 | 0.31 |
| ▸ | KDM5C | P41229 | 1/20 | 0.31 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.31 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL9839014 | 0.76 | — | — | |
| SCHEMBL888893 | 0.75 | CHRNA7 (0.36) | CHRNA7ESR1ESR2KDM4EKDM4A | |
| SCHEMBL2741630 | 0.73 | ESR1 (0.38) | CHRNA7ESR1ESR2 | |
| SCHEMBL101583 | 0.73 | CCR1 (0.50) | CHRNA7ESR1ESR2KDM4E | |
| SCHEMBL681840 | 0.71 | GBA1 (0.41) | CHRNA7KDM4E | |
| SCHEMBL179299 | 0.71 | APLNR (0.51) | CHRNA7ESR1ESR2 | |
| SCHEMBL18927439 | 0.71 | CHRNA7 (0.34) | CHRNA7ESR1ESR2KDM4EKDM4A | |
| SCHEMBL21125124 | 0.71 | TRPV4 (0.41) | CHRNA7ESR1ESR2KDM4EKDM4A | |
| SCHEMBL5371 | 0.71 | CHRNA7 (0.44) | CHRNA7ESR1ESR2KDM4E | |
| SCHEMBL31698306 | 0.71 | CHRNA7 (0.34) | CHRNA7ESR1ESR2KDM4EKDM4A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1392312-A1 | TRIAZOLO 4,5-d] PYRIMIDINE DERIVATIVES AND THEIR USE AS PURINERGIC RECEPTOR ANTAGONISTS | VERNALIS RESEARCH LIMITED (GB) | 2004-03-03 | — | — | EP | disclosed |
| WO-2002055083-A1 | TRIAZOLO[4,5-d] PYRIMIDINE DERIVATIVES AND THEIR USE AS PURINERGIC RECEPTOR ANTAGONISTS | VERNALIS RESEARCH LIMITED (GB) | 2002-07-18 | — | — | WO | disclosed |